EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H22O6 |
| Net Charge | 0 |
| Average Mass | 334.368 |
| Monoisotopic Mass | 334.14164 |
| SMILES | COc1cc(C(O)C(CO)Oc2ccc(C(C)O)cc2)ccc1O |
| InChI | InChI=1S/C18H22O6/c1-11(20)12-3-6-14(7-4-12)24-17(10-19)18(22)13-5-8-15(21)16(9-13)23-2/h3-9,11,17-22H,10H2,1-2H3 |
| InChIKey | XUONWDDRRQREJK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| lignin cw compound-133 (CHEBI:86686) is a phenylpropanoid (CHEBI:26004) |